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Pregnan-3-ol
SpectraBase Compound ID ELpxEWYyDb8
InChI InChI=1S/C21H36O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h14-19,22H,4-13H2,1-3H3
InChIKey CEBZORSAHLSRQW-UHFFFAOYSA-N
Mol Weight 304.5 g/mol
Molecular Formula C21H36O
Exact Mass 304.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4IEJSrX3MO
Name Pregnan-3-ol
CAS Registry Number 13164-34-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O
InChI InChI=1S/C21H36O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h14-19,22H,4-13H2,1-3H3
InChIKey CEBZORSAHLSRQW-UHFFFAOYSA-N
Molecular Weight 304.518 g/mol
SMILES OC1CC2C(C3C(C4CCC(C4(CC3)C)CC)CC2)(CC1)C
SPLASH splash10-05o0-8950000000-3a7b6763fc693b75707e
Source of Spectrum EP-1333-0-0
Synonyms Pregnan-3.beta.-ol 17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
Wiley ID 1307029